Crystallography Open Database

Information card for entry 7248659

Preview

Coordinates	7248659.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H16 Ag F5 O3
Calculated formula	C17 H16 Ag F5 O3
Title of publication	The atypical solubility of silver(i) pentafluorobenzoate and its use as a catch-and-release agent
Authors of publication	Ward, Jas S.
Journal of publication	CrystEngComm
Year of publication	2024
Journal volume	26
Journal issue	23
Pages of publication	3088 - 3097
a	13.9355 ± 0.0002 Å
b	5.5125 ± 0.0001 Å
c	22.5133 ± 0.0002 Å
α	90°
β	93.604 ± 0.001°
γ	90°
Cell volume	1726.04 ± 0.04 Å³
Cell temperature	120 ± 0.1 K
Ambient diffraction temperature	120 ± 0.1 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0317
Residual factor for significantly intense reflections	0.0266
Weighted residual factors for significantly intense reflections	0.0585
Weighted residual factors for all reflections included in the refinement	0.0602
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
292979 (current)	2024-07-05	cif/ Updating files of 7248652, 7248653, 7248654, 7248655, 7248656, 7248657, 7248658, 7248659, 7248660, 7248661, 7248662, 7248663, 7248664, 7248665, 7248666 Original log message: Adding full bibliography for 7248652--7248666.cif.	7248659.cif
291962	2024-05-21	cif/ Adding structures of 7248652, 7248653, 7248654, 7248655, 7248656, 7248657, 7248658, 7248659, 7248660, 7248661, 7248662, 7248663, 7248664, 7248665, 7248666 via cif-deposit CGI script.	7248659.cif